3-[2-[4-(azepan-1-yl)-4-cyclohex-3-en-1-yl-piperidin-2-yl]-2-oxidanylidene-1-piperidin-1-yl-ethyl]-3-imidazol-1-yl-oxiran-2-one

Systemtic Name: 3-[2-[4-(azepan-1-yl)-4-cyclohex-3-en-1-yl-piperidin-2-yl]-2-oxidanylidene-1-piperidin-1-yl-ethyl]-3-imidazol-1-yl-oxiran-2-one Openeye Name: 3-[2-[4-(azepan-1-yl)-4-cyclohex-3-en-1-yl-2-piperidyl]-2-oxo-1-(1-piperidyl)ethyl]-3-imidazol-1-yl-oxiran-2-one CAS Name: 3-[2-[4-(1-azepanyl)-4-(1-cyclohex-3-enyl)-2-piperidinyl]-2-oxo-1-(1-piperidinyl)ethyl]-3-(1-imidazolyl)-2-oxiranone IUPAC Name: 3-[2-[4-(azepan-1-yl)-4-cyclohex-3-en-1-ylpiperidin-2-yl]-2-oxo-1-piperidin-1-ylethyl]-3-imidazol-1-yloxiran-2-one Traditional Name: 3-[2-[4-(azepan-1-yl)-4-cyclohex-3-en-1-yl-2-piperidyl]-2-keto-1-piperidino-ethyl]-3-imidazol-1-yl-oxiran-2-one Formula: C29H43N5O3 MolecularWeight: 509.68342

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2(CCNC(C2)C(=O)C(C3(C(=O)O3)N4C=CN=C4)N5CCCCC5)C6CCC=CC6

Isomeric SMILES

C1CCCN(CC1)C2(CCNC(C2)C(=O)C(C3(C(=O)O3)N4C=CN=C4)N5CCCCC5)C6CCC=CC6

InChI

InChI=1S/C29H43N5O3/c35-25(26(32-16-7-4-8-17-32)29(27(36)37-29)34-20-15-30-22-34)24-21-28(13-14-31-24,23-11-5-3-6-12-23)33-18-9-1-2-10-19-33/h3,5,15,20,22-24,26,31H,1-2,4,6-14,16-19,21H2