N-[3-(1H-indol-3-yl)-1-[[1-[[(E)-4-methoxy-4-oxidanylidene-but-2-enyl]amino]-3-phenyl-propan-2-yl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: N-[3-(1H-indol-3-yl)-1-[[1-[[(E)-4-methoxy-4-oxidanylidene-but-2-enyl]amino]-3-phenyl-propan-2-yl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: N-[2-[[1-benzyl-2-[[(E)-4-methoxy-4-oxo-but-2-enyl]amino]ethyl]amino]-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[3-(1H-indol-3-yl)-1-[[1-[[(E)-4-methoxy-4-oxobut-2-enyl]amino]-3-phenylpropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamate IUPAC Name: N-[3-(1H-indol-3-yl)-1-[[1-[[(E)-4-methoxy-4-oxobut-2-enyl]amino]-3-phenylpropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[1-benzyl-2-[[(E)-4-keto-4-methoxy-but-2-enyl]amino]ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethyl]carbamate Formula: C27H31N4O5- MolecularWeight: 491.55884

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CC=CC=C3)CNCC=CC(=O)OC)NC(=O)[O-]

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CC=CC=C3)CNC/C=C/C(=O)OC)NC(=O)[O-]

InChI

InChI=1S/C27H32N4O5/c1-27(31-26(34)35,16-20-17-29-23-12-7-6-11-22(20)23)25(33)30-21(15-19-9-4-3-5-10-19)18-28-14-8-13-24(32)36-2/h3-13,17,21,28-29,31H,14-16,18H2,1-2H3,(H,30,33)(H,34,35)/p-1/b13-8+