N-[3-azanyl-1-[4-(1H-pyrazol-4-yl)phenyl]propyl]-3-methoxy-benzamide; methanoic acid

Systemtic Name: N-[3-azanyl-1-[4-(1H-pyrazol-4-yl)phenyl]propyl]-3-methoxy-benzamide; methanoic acid Openeye Name: N-[3-amino-1-[4-(1H-pyrazol-4-yl)phenyl]propyl]-3-methoxy-benzamide; formic acid CAS Name: N-[3-amino-1-[4-(1H-pyrazol-4-yl)phenyl]propyl]-3-methoxybenzamide; formic acid IUPAC Name: N-[3-amino-1-[4-(1H-pyrazol-4-yl)phenyl]propyl]-3-methoxybenzamide; formic acid Traditional Name: N-[3-amino-1-[4-(1H-pyrazol-4-yl)phenyl]propyl]-3-methoxy-benzamide; formic acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(CCN)C2=CC=C(C=C2)C3=CNN=C3.C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(CCN)C2=CC=C(C=C2)C3=CNN=C3.C(=O)O

InChI

InChI=1S/C20H22N4O2.CH2O2/c1-26-18-4-2-3-16(11-18)20(25)24-19(9-10-21)15-7-5-14(6-8-15)17-12-22-23-13-17;2-1-3/h2-8,11-13,19H,9-10,21H2,1H3,(H,22,23)(H,24,25);1H,(H,2,3)