N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)propanamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propionamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC3=C(N(N=C3C)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC3=C(N(N=C3C)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H29N3O4/c1-17-22-11-10-21(33-4)14-25(22)34-27(32)23(17)12-13-26(31)28-15-24-18(2)29-30(19(24)3)16-20-8-6-5-7-9-20/h5-11,14H,12-13,15-16H2,1-4H3,(H,28,31)