[4-[cyclohexylmethyl(cyclopropyl)amino]-1-(3-methoxyphenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[cyclohexylmethyl(cyclopropyl)amino]-1-(3-methoxyphenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[cyclohexylmethyl(cyclopropyl)amino]-1-(3-methoxybenzoyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[cyclohexylmethyl(cyclopropyl)amino]-1-[(3-methoxyphenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[cyclohexylmethyl(cyclopropyl)amino]-1-(3-methoxybenzoyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[cyclohexylmethyl(cyclopropyl)amino]-1-m-anisoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C27H40N4O3 MolecularWeight: 468.6315

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4CCCCC4)C5CC5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4CCCCC4)C5CC5

InChI

InChI=1S/C27H40N4O3/c1-34-24-9-5-8-21(16-24)26(32)31-19-23(17-25(31)27(33)29-14-12-28-13-15-29)30(22-10-11-22)18-20-6-3-2-4-7-20/h5,8-9,16,20,22-23,25,28H,2-4,6-7,10-15,17-19H2,1H3