4-[[4-(4-methylpiperidin-1-yl)phenyl]amino]-3-nitro-chromen-2-one

Systemtic Name: 4-[[4-(4-methylpiperidin-1-yl)phenyl]amino]-3-nitro-chromen-2-one Openeye Name: 4-[4-(4-methyl-1-piperidyl)anilino]-3-nitro-chromen-2-one CAS Name: 4-[4-(4-methyl-1-piperidinyl)anilino]-3-nitro-1-benzopyran-2-one IUPAC Name: 4-[4-(4-methylpiperidin-1-yl)anilino]-3-nitrochromen-2-one Traditional Name: 4-[4-(4-methylpiperidino)anilino]-3-nitro-coumarin Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC3=C(C(=O)OC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC3=C(C(=O)OC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-14-10-12-23(13-11-14)16-8-6-15(7-9-16)22-19-17-4-2-3-5-18(17)28-21(25)20(19)24(26)27/h2-9,14,22H,10-13H2,1H3