N-(3-azanylpropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxidanylidene-chromen-2-yl]-2-methyl-propyl]-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxidanylidene-chromen-2-yl]-2-methyl-propyl]-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxo-chromen-2-yl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxo-1-benzopyran-2-yl]-2-methylpropyl]-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxochromen-2-yl]-2-methylpropyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-[3-(3-cyanobenzyl)-4-keto-7-methoxy-chromen-2-yl]-2-methyl-propyl]-4-methyl-benzamide Formula: C33H35N3O4 MolecularWeight: 537.6487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=C(C(=O)C3=C(O2)C=C(C=C3)OC)CC4=CC=CC(=C4)C#N)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=C(C(=O)C3=C(O2)C=C(C=C3)OC)CC4=CC=CC(=C4)C#N)C(C)C

InChI

InChI=1S/C33H35N3O4/c1-21(2)30(36(16-6-15-34)33(38)25-11-9-22(3)10-12-25)32-28(18-23-7-5-8-24(17-23)20-35)31(37)27-14-13-26(39-4)19-29(27)40-32/h5,7-14,17,19,21,30H,6,15-16,18,34H2,1-4H3