O1-(2-chloranyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) O4-(phenylmethyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate

Systemtic Name: O1-(2-chloranyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) O4-(phenylmethyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Openeye Name: O4-benzyl O1-(2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 2-(tert-butoxycarbonylamino)butanedioate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid O1-(2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl) ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-(2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Traditional Name: 2-(tert-butoxycarbonylamino)succinic acid O4-benzyl ester O1-(2-chloro-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) ester Formula: C29H30ClNO8 MolecularWeight: 556.0034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)OC2=C(C=C3C4=C(CCCC4)C(=O)OC3=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)OC2=C(C=C3C4=C(CCCC4)C(=O)OC3=C2)Cl

InChI

InChI=1S/C29H30ClNO8/c1-29(2,3)39-28(35)31-22(14-25(32)36-16-17-9-5-4-6-10-17)27(34)38-24-15-23-20(13-21(24)30)18-11-7-8-12-19(18)26(33)37-23/h4-6,9-10,13,15,22H,7-8,11-12,14,16H2,1-3H3,(H,31,35)