2,6-bis(azanyl)hexanoic acid; (4-methoxyphenyl)methanamine; 4-phenylbenzaldehyde

Systemtic Name: 2,6-bis(azanyl)hexanoic acid; (4-methoxyphenyl)methanamine; 4-phenylbenzaldehyde Openeye Name: 2,6-diaminohexanoic acid; (4-methoxyphenyl)methanamine; 4-phenylbenzaldehyde CAS Name: 2,6-diaminohexanoic acid; (4-methoxyphenyl)methanamine; 4-phenylbenzaldehyde IUPAC Name: 2,6-diaminohexanoic acid; (4-methoxyphenyl)methanamine; 4-phenylbenzaldehyde Traditional Name: 2,6-diaminohexanoic acid; p-anisylamine; 4-phenylbenzaldehyde Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN.C1=CC=C(C=C1)C2=CC=C(C=C2)C=O.C(CCN)CC(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)CN.C1=CC=C(C=C1)C2=CC=C(C=C2)C=O.C(CCN)CC(C(=O)O)N

InChI

InChI=1S/C13H10O.C8H11NO.C6H14N2O2/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12;1-10-8-4-2-7(6-9)3-5-8;7-4-2-1-3-5(8)6(9)10/h1-10H;2-5H,6,9H2,1H3;5H,1-4,7-8H2,(H,9,10)