N-(3-azanylpropyl)-N-[1-[7-cyano-4-oxidanylidene-3-(phenylmethyl)chromen-2-yl]-2-methyl-propyl]-4-ethanoyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[7-cyano-4-oxidanylidene-3-(phenylmethyl)chromen-2-yl]-2-methyl-propyl]-4-ethanoyl-benzamide Openeye Name: 4-acetyl-N-(3-aminopropyl)-N-[1-(3-benzyl-7-cyano-4-oxo-chromen-2-yl)-2-methyl-propyl]benzamide CAS Name: 4-acetyl-N-(3-aminopropyl)-N-[1-[7-cyano-4-oxo-3-(phenylmethyl)-1-benzopyran-2-yl]-2-methylpropyl]benzamide IUPAC Name: 4-acetyl-N-(3-aminopropyl)-N-[1-(3-benzyl-7-cyano-4-oxochromen-2-yl)-2-methylpropyl]benzamide Traditional Name: 4-acetyl-N-(3-aminopropyl)-N-[1-(3-benzyl-7-cyano-4-keto-chromen-2-yl)-2-methyl-propyl]benzamide Formula: C33H33N3O4 MolecularWeight: 535.63282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C(=O)C2=C(O1)C=C(C=C2)C#N)CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC(C)C(C1=C(C(=O)C2=C(O1)C=C(C=C2)C#N)CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C33H33N3O4/c1-21(2)30(36(17-7-16-34)33(39)26-13-11-25(12-14-26)22(3)37)32-28(18-23-8-5-4-6-9-23)31(38)27-15-10-24(20-35)19-29(27)40-32/h4-6,8-15,19,21,30H,7,16-18,34H2,1-3H3