2-aminocarbonyl-6-azanyl-3-phenyl-5-[(phenylmethyl)iminomethyl]-4-piperidin-4-yloxy-benzoic acid

Systemtic Name: 2-aminocarbonyl-6-azanyl-3-phenyl-5-[(phenylmethyl)iminomethyl]-4-piperidin-4-yloxy-benzoic acid Openeye Name: 2-amino-3-(benzyliminomethyl)-6-carbamoyl-5-phenyl-4-(4-piperidyloxy)benzoic acid CAS Name: 2-amino-6-carbamoyl-5-phenyl-3-[(phenylmethyl)iminomethyl]-4-(4-piperidinyloxy)benzoic acid IUPAC Name: 2-amino-3-(benzyliminomethyl)-6-carbamoyl-5-phenyl-4-piperidin-4-yloxybenzoic acid Traditional Name: 2-amino-3-(benzyliminomethyl)-6-carbamoyl-5-phenyl-4-(4-piperidyloxy)benzoic acid Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC2=C(C(=C(C(=C2C3=CC=CC=C3)C(=O)N)C(=O)O)N)C=NCC4=CC=CC=C4

Isomeric SMILES

C1CNCCC1OC2=C(C(=C(C(=C2C3=CC=CC=C3)C(=O)N)C(=O)O)N)C=NCC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O4/c28-24-20(16-31-15-17-7-3-1-4-8-17)25(35-19-11-13-30-14-12-19)21(18-9-5-2-6-10-18)22(26(29)32)23(24)27(33)34/h1-10,16,19,30H,11-15,28H2,(H2,29,32)(H,33,34)