1-[(4-isocyanophenyl)carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-isocyanophenyl)carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-isocyanophenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-isocyanoanilino)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-isocyanophenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[(4-isocyanophenyl)carbamoyl]nipecotic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)NC(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)NC(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C14H15N3O3/c1-15-11-4-6-12(7-5-11)16-14(20)17-8-2-3-10(9-17)13(18)19/h4-7,10H,2-3,8-9H2,(H,16,20)(H,18,19)