N-[4-[3-oxidanyl-2-[(2-oxidanyl-3-phenoxy-propyl)-(phenylmethyl)amino]propyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[3-oxidanyl-2-[(2-oxidanyl-3-phenoxy-propyl)-(phenylmethyl)amino]propyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[2-[benzyl-(2-hydroxy-3-phenoxy-propyl)amino]-3-hydroxy-propyl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-[3-hydroxy-2-[(2-hydroxy-3-phenoxypropyl)-(phenylmethyl)amino]propyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[2-[benzyl-(2-hydroxy-3-phenoxypropyl)amino]-3-hydroxypropyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[2-[benzyl-(2-hydroxy-3-phenoxy-propyl)amino]-3-hydroxy-propyl]phenyl]nicotinamide Formula: C31H33N3O4 MolecularWeight: 511.61142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC(COC2=CC=CC=C2)O)C(CC3=CC=C(C=C3)NC(=O)C4=CN=CC=C4)CO

Isomeric SMILES

C1=CC=C(C=C1)CN(CC(COC2=CC=CC=C2)O)C(CC3=CC=C(C=C3)NC(=O)C4=CN=CC=C4)CO

InChI

InChI=1S/C31H33N3O4/c35-22-28(18-24-13-15-27(16-14-24)33-31(37)26-10-7-17-32-19-26)34(20-25-8-3-1-4-9-25)21-29(36)23-38-30-11-5-2-6-12-30/h1-17,19,28-29,35-36H,18,20-23H2,(H,33,37)