[4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[cyclohexylmethyl(m-anisyl)amino]-1-nicotinoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C30H41N5O3 MolecularWeight: 519.67824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2CCCCC2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2CCCCC2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C30H41N5O3/c1-38-27-11-5-9-24(17-27)21-34(20-23-7-3-2-4-8-23)26-18-28(30(37)33-15-13-31-14-16-33)35(22-26)29(36)25-10-6-12-32-19-25/h5-6,9-12,17,19,23,26,28,31H,2-4,7-8,13-16,18,20-22H2,1H3