N-[2-[2-(1H-indol-3-yl)ethyl-[(2-methoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(1H-indol-3-yl)ethyl-[(2-methoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Openeye Name: N-[2-[2-(1H-indol-3-yl)ethyl-[(2-methoxyphenyl)methyl]amino]-2-oxo-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide CAS Name: N-[2-[2-(1H-indol-3-yl)ethyl-[(2-methoxyphenyl)methyl]amino]-2-oxoethyl]-N-(3-methoxypropyl)-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(1H-indol-3-yl)ethyl-[(2-methoxyphenyl)methyl]amino]-2-oxoethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Traditional Name: N-[2-[2-(1H-indol-3-yl)ethyl-o-anisyl-amino]-2-keto-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Formula: C35H45N3O4 MolecularWeight: 571.7495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3OC)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COCCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3OC)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C35H45N3O4/c1-41-15-7-13-38(34(40)35-19-25-16-26(20-35)18-27(17-25)21-35)24-33(39)37(23-29-8-3-6-11-32(29)42-2)14-12-28-22-36-31-10-5-4-9-30(28)31/h3-6,8-11,22,25-27,36H,7,12-21,23-24H2,1-2H3