3-azanyl-N-[1-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-2-phenylazanyl-ethyl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide

Systemtic Name: 3-azanyl-N-[1-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-2-phenylazanyl-ethyl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide Openeye Name: 3-amino-N-[2-anilino-1-(4-chloro-3-nitro-phenyl)-2-oxo-ethyl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide CAS Name: 3-amino-N-[2-anilino-1-(4-chloro-3-nitrophenyl)-2-oxoethyl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide IUPAC Name: 3-amino-N-[2-anilino-1-(4-chloro-3-nitrophenyl)-2-oxoethyl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide Traditional Name: 3-amino-N-[2-anilino-1-(4-chloro-3-nitro-phenyl)-2-keto-ethyl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propionamide Formula: C28H28ClN5O5 MolecularWeight: 550.00542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN2)CCN(C(C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)NC4=CC=CC=C4)C(=O)CCN

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN2)CCN(C(C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)NC4=CC=CC=C4)C(=O)CCN

InChI

InChI=1S/C28H28ClN5O5/c1-39-21-8-9-22-19(17-31-24(22)16-21)12-14-33(26(35)11-13-30)27(28(36)32-20-5-3-2-4-6-20)18-7-10-23(29)25(15-18)34(37)38/h2-10,15-17,27,31H,11-14,30H2,1H3,(H,32,36)