4-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]-3-nitro-benzaldehyde

Systemtic Name: 4-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]-3-nitro-benzaldehyde Openeye Name: 4-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]-3-nitro-benzaldehyde CAS Name: 4-[[4-(4-morpholin-4-iumylmethyl)phenyl]methylamino]-3-nitrobenzaldehyde IUPAC Name: 4-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]-3-nitrobenzaldehyde Traditional Name: 4-[[4-(morpholin-4-ium-4-ylmethyl)benzyl]amino]-3-nitro-benzaldehyde Formula: C19H22N3O4+ MolecularWeight: 356.39568

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)CNC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)CNC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4/c23-14-17-5-6-18(19(11-17)22(24)25)20-12-15-1-3-16(4-2-15)13-21-7-9-26-10-8-21/h1-6,11,14,20H,7-10,12-13H2/p+1