(phenylmethyl) 6-[azanyl(4-naphthalen-2-ylbutanoyl)amino]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate

Systemtic Name: (phenylmethyl) 6-[azanyl(4-naphthalen-2-ylbutanoyl)amino]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate Openeye Name: benzyl 6-[amino-[4-(2-naphthyl)butanoyl]amino]-5-(tert-butoxycarbonylamino)-6-oxo-hexanoate CAS Name: 6-[amino-[4-(2-naphthalenyl)-1-oxobutyl]amino]-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[amino(4-naphthalen-2-ylbutanoyl)amino]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoate Traditional Name: 6-[amino-[4-(2-naphthyl)butanoyl]amino]-5-(tert-butoxycarbonylamino)-6-keto-hexanoic acid benzyl ester Formula: C32H39N3O6 MolecularWeight: 561.66856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)N(C(=O)CCCC2=CC3=CC=CC=C3C=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)N(C(=O)CCCC2=CC3=CC=CC=C3C=C2)N

InChI

InChI=1S/C32H39N3O6/c1-32(2,3)41-31(39)34-27(16-10-18-29(37)40-22-24-11-5-4-6-12-24)30(38)35(33)28(36)17-9-13-23-19-20-25-14-7-8-15-26(25)21-23/h4-8,11-12,14-15,19-21,27H,9-10,13,16-18,22,33H2,1-3H3,(H,34,39)