N-[3-[[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-keto-propyl]adamantane-1-carboxamide Formula: C27H41N3O3 MolecularWeight: 455.63274

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)CCNC(=O)C12CC3CC(C1)CC(C3)C2)C4=CC(=CC=C4)OC

Isomeric SMILES

CCN(CC)C(CNC(=O)CCNC(=O)C12CC3CC(C1)CC(C3)C2)C4=CC(=CC=C4)OC

InChI

InChI=1S/C27H41N3O3/c1-4-30(5-2)24(22-7-6-8-23(14-22)33-3)18-29-25(31)9-10-28-26(32)27-15-19-11-20(16-27)13-21(12-19)17-27/h6-8,14,19-21,24H,4-5,9-13,15-18H2,1-3H3,(H,28,32)(H,29,31)