N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-cyclohexanecarboxamide

Systemtic Name: N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-cyclohexanecarboxamide Openeye Name: N-allyl-N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-N-prop-2-enylcyclohexanecarboxamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-prop-2-enylcyclohexanecarboxamide Traditional Name: N-allyl-N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]cyclohexanecarboxamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)C(=O)C3CCCCC3

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)C(=O)C3CCCCC3

InChI

InChI=1S/C25H33N3O2/c1-3-16-27(25(30)22-13-8-5-9-14-22)20-24(29)28(18-21-11-6-4-7-12-21)19-23-15-10-17-26(23)2/h3-4,6-7,10-12,15,17,22H,1,5,8-9,13-14,16,18-20H2,2H3